3-[2-chloranyl-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one

Systemtic Name: 3-[2-chloranyl-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one Openeye Name: 3-[2-chloro-6-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one CAS Name: 3-[2-chloro-6-[[3-(2-quinolinylmethoxy)phenoxy]methyl]phenoxy]-2-hexanone IUPAC Name: 3-[2-chloro-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one Traditional Name: 3-[2-chloro-6-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]hexan-2-one Formula: C29H28ClNO4 MolecularWeight: 489.98992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C)OC1=C(C=CC=C1Cl)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCCC(C(=O)C)OC1=C(C=CC=C1Cl)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H28ClNO4/c1-3-8-28(20(2)32)35-29-22(10-6-13-26(29)30)18-33-24-11-7-12-25(17-24)34-19-23-16-15-21-9-4-5-14-27(21)31-23/h4-7,9-17,28H,3,8,18-19H2,1-2H3